| SpectraBase Compound ID | 6B1i5pfOWzv |
|---|---|
| InChI | InChI=1S/C21H14O3/c1-24-18-12-5-4-7-13(18)14-10-6-11-17-19(14)21(23)16-9-3-2-8-15(16)20(17)22/h2-12H,1H3 |
| InChIKey | HLKNRNPTFCTXDQ-UHFFFAOYSA-N |
| Mol Weight | 314.34 g/mol |
| Molecular Formula | C21H14O3 |
| Exact Mass | 314.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9SsdveCDIU6 |
|---|---|
| Name | 9,10-Anthracenedione, 1-(2-methoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.094294308 u |
| Formula | C21H14O3 |
| InChI | InChI=1S/C21H14O3/c1-24-18-12-5-4-7-13(18)14-10-6-11-17-19(14)21(23)16-9-3-2-8-15(16)20(17)22/h2-12H,1H3 |
| InChIKey | HLKNRNPTFCTXDQ-UHFFFAOYSA-N |
| Molecular Weight | 314.340 g/mol |
| SMILES | C1(=O)C2=C(C=CC=C2C(C2=C1C=CC=C2)=O)C1=C(OC)C=CC=C1 |